(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)-(3-propan-2-yloxypropyl)azanium

Systemtic Name: (2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)-(3-propan-2-yloxypropyl)azanium Openeye Name: (2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)-(3-isopropoxypropyl)ammonium CAS Name: (2-ethyl-4-benzofuro[3,2-d]pyrimidinyl)-(3-propan-2-yloxypropyl)ammonium IUPAC Name: (2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)-(3-propan-2-yloxypropyl)azanium Traditional Name: (2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)-(3-isopropoxypropyl)ammonium Formula: C18H24N3O2+ MolecularWeight: 314.40206

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=N1)[NH2+]CCCOC(C)C)OC3=CC=CC=C32

Isomeric SMILES

CCC1=NC2=C(C(=N1)[NH2+]CCCOC(C)C)OC3=CC=CC=C32

InChI

InChI=1S/C18H23N3O2/c1-4-15-20-16-13-8-5-6-9-14(13)23-17(16)18(21-15)19-10-7-11-22-12(2)3/h5-6,8-9,12H,4,7,10-11H2,1-3H3,(H,19,20,21)/p+1